5-[bis(azanyl)methylideneamino]-2-[butan-2-yl(hexanoyl)amino]pentanoic acid

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[butan-2-yl(hexanoyl)amino]pentanoic acid Openeye Name: 5-guanidino-2-[hexanoyl(sec-butyl)amino]pentanoic acid CAS Name: 2-[butan-2-yl(1-oxohexyl)amino]-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-[butan-2-yl(hexanoyl)amino]-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-[caproyl(sec-butyl)amino]-5-guanidino-valeric acid Formula: C16H32N4O3 MolecularWeight: 328.45028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N(C(C)CC)C(CCCN=C(N)N)C(=O)O

Isomeric SMILES

CCCCCC(=O)N(C(C)CC)C(CCCN=C(N)N)C(=O)O

InChI

InChI=1S/C16H32N4O3/c1-4-6-7-10-14(21)20(12(3)5-2)13(15(22)23)9-8-11-19-16(17)18/h12-13H,4-11H2,1-3H3,(H,22,23)(H4,17,18,19)